Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3tml_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 2.A N VAL 9.A O no hydrogen 2.828 N/A LEU 4.A N PHE 7.A O no hydrogen 2.848 N/A PHE 7.A N LEU 4.A O no hydrogen 3.150 N/A VAL 9.A N MET 2.A O no hydrogen 2.792 N/A GLN 13.A N GLY 10.A O no hydrogen 2.990 N/A GLN 13.A NE2 ASP 12.A OD2 no hydrogen 2.633 N/A PHE 15.A N ASP 249.A OD2 no hydrogen 2.945 N/A PHE 16.A N ALA 212.A O no hydrogen 3.108 N/A LEU 17.A N PRO 47.A O no hydrogen 2.828 N/A ILE 18.A N LEU 214.A O no hydrogen 2.832 N/A ALA 19.A N ILE 49.A O no hydrogen 3.127 N/A THR 21.A OG1 VAL 23.A O no hydrogen 2.794 N/A THR 21.A OG1 SER 52.A OG no hydrogen 3.155 N/A CYS 22.A SG GLU 217.A OE2 no hydrogen 3.373 N/A VAL 24.A N SER 53.A O no hydrogen 2.841 N/A MET 29.A N SER 26.A OG no hydrogen 3.266 N/A THR 30.A N SER 26.A O no hydrogen 3.003 N/A THR 30.A OG1 SER 26.A O no hydrogen 2.654 N/A ILE 31.A N GLU 27.A O no hydrogen 2.791 N/A ASP 32.A N GLN 28.A O no hydrogen 2.959 N/A THR 33.A N MET 29.A O no hydrogen 3.110 N/A THR 33.A OG1 MET 29.A O no hydrogen 2.845 N/A ALA 34.A N THR 30.A O no hydrogen 2.958 N/A GLY 35.A N ILE 31.A O no hydrogen 3.011 N/A ARG 36.A N ASP 32.A O no hydrogen 3.021 N/A LEU 37.A N THR 33.A O no hydrogen 3.015 N/A LYS 38.A N ALA 34.A O no hydrogen 2.953 N/A LYS 38.A NZ LEU 70.A O no hydrogen 2.628 N/A GLU 39.A N GLY 35.A O no hydrogen 3.106 N/A ILE 40.A N ARG 36.A O no hydrogen 2.958 N/A CYS 41.A N LEU 37.A O no hydrogen 2.866 N/A CYS 41.A SG LEU 37.A O no hydrogen 3.361 N/A GLU 42.A N LYS 38.A O no hydrogen 2.862 N/A LYS 43.A N GLU 39.A O no hydrogen 3.105 N/A LEU 44.A N ILE 40.A O no hydrogen 3.323 N/A LEU 44.A N CYS 41.A O no hydrogen 3.190 N/A ASN 45.A N GLU 42.A O no hydrogen 3.313 N/A VAL 46.A N CYS 41.A O no hydrogen 2.966 N/A ILE 49.A N LEU 17.A O no hydrogen 2.829 N/A TYR 50.A N PRO 73.A O no hydrogen 2.951 N/A TYR 50.A OH SER 52.A OG no hydrogen 2.633 N/A LYS 51.A N ALA 19.A O no hydrogen 3.051 N/A LYS 51.A NZ CYS 22.A O no hydrogen 2.804 N/A LYS 51.A NZ SER 53.A OG no hydrogen 3.224 N/A SER 52.A OG THR 21.A O no hydrogen 2.904 N/A SER 52.A OG THR 21.A OG1 no hydrogen 3.155 N/A SER 52.A OG TYR 50.A OH no hydrogen 2.633 N/A SER 52.A OG LYS 51.A O no hydrogen 2.780 N/A SER 53.A N CYS 22.A O no hydrogen 3.150 N/A SER 53.A OG CYS 22.A O no hydrogen 3.465 N/A SER 53.A OG ASP 77.A OD2 no hydrogen 2.580 N/A TYR 54.A OH ASP 77.A O no hydrogen 3.302 N/A TYR 54.A OH GLU 83.A OE1 no hydrogen 2.618 N/A GLY 59.A N GLY 55.A O no hydrogen 2.944 N/A LEU 60.A N MET 56.A O no hydrogen 2.993 N/A ARG 61.A N ASP 57.A O no hydrogen 3.056 N/A ARG 61.A NE GLU 58.A OE1 no hydrogen 3.465 N/A ARG 61.A NE GLU 58.A OE2 no hydrogen 3.319 N/A ARG 61.A NH1 GLU 27.A OE1 no hydrogen 3.225 N/A ARG 61.A NH2 GLU 27.A OE1 no hydrogen 3.327 N/A ARG 61.A NH2 GLU 58.A OE2 no hydrogen 2.554 N/A ILE 62.A N GLU 58.A O no hydrogen 3.090 N/A LEU 63.A N GLY 59.A O no hydrogen 2.964 N/A SER 64.A N LEU 60.A O no hydrogen 2.894 N/A SER 64.A OG.A ARG 61.A O no hydrogen 2.535 N/A SER 64.A OG.B LEU 60.A O no hydrogen 2.831 N/A GLU 65.A N ARG 61.A O no hydrogen 3.146 N/A GLU 65.A N ILE 62.A O no hydrogen 2.993 N/A VAL 66.A N ILE 62.A O no hydrogen 3.146 N/A LYS 67.A N LEU 63.A O no hydrogen 3.354 N/A LYS 67.A NZ ASP 92.A OD1 no hydrogen 2.901 N/A LYS 67.A NZ ASP 92.A OD2 no hydrogen 2.812 N/A ARG 68.A N SER 64.A O no hydrogen 2.909 N/A ARG 68.A NE GLU 65.A OE1 no hydrogen 2.683 N/A ARG 68.A NH2 GLU 65.A OE1 no hydrogen 3.429 N/A ARG 68.A NH2 GLU 65.A OE2 no hydrogen 2.798 N/A GLN 69.A N GLU 65.A O no hydrogen 2.832 N/A LEU 70.A N VAL 66.A O no hydrogen 2.899 N/A GLY 71.A N LYS 67.A O no hydrogen 2.783 N/A VAL 74.A N ASP 92.A OD2 no hydrogen 2.819 N/A LEU 75.A N TYR 50.A O no hydrogen 2.875 N/A THR 76.A N VAL 93.A O no hydrogen 3.306 N/A THR 76.A OG1 SER 52.A O no hydrogen 2.925 N/A VAL 78.A N GLN 95.A O no hydrogen 3.054 N/A HIS 79.A N GLU 83.A OE1 no hydrogen 3.114 N/A SER 80.A OG ASP 82.A OD1 no hydrogen 2.561 N/A GLU 83.A N SER 80.A O no hydrogen 3.155 N/A ILE 84.A N ILE 81.A O no hydrogen 3.244 N/A GLN 86.A NE2 ASP 57.A OD1 no hydrogen 3.298 N/A VAL 87.A N GLU 83.A O no hydrogen 3.003 N/A ALA 88.A N ILE 84.A O no hydrogen 2.895 N/A SER 89.A N GLU 85.A O no hydrogen 3.169 N/A SER 89.A OG GLU 85.A O no hydrogen 3.569 N/A SER 89.A OG GLN 86.A O no hydrogen 2.562 N/A VAL 90.A N VAL 87.A O no hydrogen 2.905 N/A VAL 91.A N VAL 87.A O no hydrogen 2.919 N/A ASP 92.A N VAL 74.A O no hydrogen 2.811 N/A VAL 93.A N VAL 74.A O no hydrogen 3.119 N/A LEU 94.A N PRO 116.A O no hydrogen 2.879 N/A GLN 95.A N THR 76.A O no hydrogen 2.982 N/A GLN 95.A NE2 ASP 77.A OD1 no hydrogen 2.858 N/A THR 96.A N ASN 118.A O no hydrogen 3.105 N/A LEU 100.A N PRO 97.A O no hydrogen 3.141 N/A CYS 101.A N ALA 98.A O no hydrogen 3.188 N/A CYS 101.A SG ALA 98.A O no hydrogen 3.221 N/A GLN 103.A N LEU 100.A O no hydrogen 2.908 N/A GLN 103.A NE2 ASP 105.A OD1 no hydrogen 3.343 N/A PHE 106.A N ASP 105.A OD1 no hydrogen 2.715 N/A ILE 107.A N GLN 103.A O no hydrogen 2.943 N/A HIS 108.A N THR 104.A O no hydrogen 2.786 N/A ALA 109.A N ASP 105.A O no hydrogen 2.970 N/A CYS 110.A N PHE 106.A O no hydrogen 3.022 N/A CYS 110.A SG PHE 106.A O no hydrogen 3.483 N/A ALA 111.A N ILE 107.A O no hydrogen 2.887 N/A ARG 112.A N HIS 108.A O no hydrogen 3.027 N/A SER 113.A N CYS 110.A O no hydrogen 3.006 N/A SER 113.A OG CYS 110.A O no hydrogen 2.690 N/A LYS 115.A N SER 113.A OG no hydrogen 3.051 N/A LYS 115.A NZ ALA 88.A O no hydrogen 2.481 N/A LYS 115.A NZ VAL 91.A O no hydrogen 3.025 N/A VAL 117.A N ARG 150.A O no hydrogen 2.962 N/A ASN 118.A N LEU 94.A O no hydrogen 2.881 N/A ASN 118.A ND2 GLN 95.A OE1 no hydrogen 2.987 N/A ILE 119.A N MET 152.A O no hydrogen 2.826 N/A LYS 120.A N THR 96.A OG1 no hydrogen 3.348 N/A LYS 120.A NZ ASP 185.A OD2 no hydrogen 2.700 N/A LYS 120.A NZ HIS 188.A ND1 no hydrogen 3.548 N/A LYS 121.A N CYS 154.A O no hydrogen 2.893 N/A LYS 121.A NZ GLU 155.A OE1 no hydrogen 2.856 N/A GLN 123.A N GLN 123.A OE1 no hydrogen 2.652 N/A LEU 125.A N GLY 122.A O no hydrogen 2.983 N/A ALA 126.A N ASP 129.A OD2 no hydrogen 3.027 N/A HIS 128.A ND1.A GLU 177.A OE2 no hydrogen 2.536 N/A HIS 128.A ND1.B GLU 177.A OE2 no hydrogen 2.909 N/A ASP 129.A N ALA 126.A O no hydrogen 2.892 N/A MET 130.A N PRO 127.A O no hydrogen 3.210 N/A LYS 131.A NZ ASP 135.A OD2 no hydrogen 3.240 N/A VAL 133.A N ASP 129.A O no hydrogen 3.491 N/A ILE 134.A N MET 130.A O no hydrogen 2.877 N/A ASP 135.A N LYS 131.A O no hydrogen 2.799 N/A LYS 136.A N ASN 132.A O no hydrogen 2.995 N/A ALA 137.A N VAL 133.A O no hydrogen 3.055 N/A ARG 138.A N ILE 134.A O no hydrogen 2.906 N/A ARG 138.A NE GLU 148.A O no hydrogen 3.075 N/A ARG 138.A NH1 THR 178.A O no hydrogen 2.764 N/A ARG 138.A NH2 ASN 179.A O no hydrogen 2.959 N/A ASP 139.A N ASP 135.A O no hydrogen 2.892 N/A ALA 140.A N LYS 136.A O no hydrogen 3.113 N/A ALA 141.A N ALA 137.A O no hydrogen 2.982 N/A ARG 142.A N ARG 138.A O no hydrogen 2.888 N/A ARG 142.A NH1 ASP 139.A OD1 no hydrogen 3.244 N/A ARG 142.A NH1 GLU 148.A OE2 no hydrogen 2.671 N/A ARG 142.A NH2 ASP 139.A OD1 no hydrogen 3.134 N/A GLU 143.A N ASP 139.A O no hydrogen 2.811 N/A ALA 144.A N ALA 141.A O no hydrogen 2.895 N/A GLY 145.A N ARG 142.A O no hydrogen 2.976 N/A LEU 146.A N ALA 141.A O no hydrogen 3.065 N/A ARG 150.A NE SER 147.A O no hydrogen 2.944 N/A ARG 150.A NH1 SER 147.A OG no hydrogen 3.050 N/A MET 152.A N VAL 117.A O no hydrogen 2.939 N/A ALA 153.A N PRO 181.A O no hydrogen 2.991 N/A CYS 154.A N ILE 119.A O no hydrogen 2.853 N/A CYS 154.A SG GLU 155.A O no hydrogen 3.978 N/A CYS 154.A SG VAL 183.A O no hydrogen 3.706 N/A GLU 155.A N VAL 183.A O no hydrogen 2.780 N/A ARG 156.A NH1 ARG 156.A O no hydrogen 2.903 N/A GLY 157.A N GLU 155.A OE2 no hydrogen 2.889 N/A VAL 158.A N VAL 166.A O no hydrogen 3.039 N/A SER 159.A N GLN 123.A O no hydrogen 3.035 N/A PHE 160.A N ASN 164.A O no hydrogen 2.975 N/A ASN 163.A ND2 PRO 193.A O no hydrogen 2.820 N/A VAL 166.A N VAL 158.A O no hydrogen 2.910 N/A ARG 170.A N ASP 168.A OD1 no hydrogen 3.097 N/A ARG 170.A NE ASP 168.A OD1 no hydrogen 3.108 N/A ARG 170.A NE ASP 168.A OD2 no hydrogen 3.179 N/A ARG 170.A NH2 ASP 168.A OD2 no hydrogen 2.865 N/A SER 171.A N ASP 168.A O no hydrogen 2.863 N/A SER 171.A OG GLU 155.A OE1 no hydrogen 2.736 N/A ILE 174.A N ARG 170.A O no hydrogen 2.845 N/A MET 175.A N SER 171.A O no hydrogen 2.862 N/A ARG 176.A N ALA 173.A O no hydrogen 3.172 N/A ARG 176.A NH1 GLU 259.A OE2 no hydrogen 2.833 N/A ARG 176.A NH2 THR 209.A O no hydrogen 2.895 N/A ARG 176.A NH2 GLY 210.A O no hydrogen 3.024 N/A GLU 177.A N ILE 174.A O no hydrogen 3.002 N/A THR 178.A N MET 175.A O no hydrogen 2.933 N/A THR 178.A OG1 MET 175.A O no hydrogen 2.700 N/A ASN 179.A N ARG 176.A O no hydrogen 3.056 N/A ALA 180.A N THR 178.A OG1 no hydrogen 3.144 N/A VAL 183.A N ALA 153.A O no hydrogen 2.824 N/A PHE 184.A N GLY 213.A O no hydrogen 2.938 N/A ASP 185.A N GLU 155.A O no hydrogen 2.853 N/A ALA 186.A N PHE 215.A O no hydrogen 3.001 N/A HIS 188.A N ASP 185.A OD1 no hydrogen 2.906 N/A HIS 188.A ND1 ASP 185.A OD1 no hydrogen 3.158 N/A HIS 188.A ND1 ASP 185.A OD2 no hydrogen 2.672 N/A SER 189.A N ASP 185.A O no hydrogen 3.247 N/A SER 189.A OG ASP 185.A O no hydrogen 2.719 N/A GLN 191.A N HIS 188.A O no hydrogen 3.253 N/A GLN 195.A N ASN 231.A OD1 no hydrogen 2.797 N/A ARG 196.A NE.B ALA 232.A O no hydrogen 2.672 N/A ARG 196.A NH1.B GLY 229.A O no hydrogen 2.526 N/A PHE 198.A N GLN 195.A O no hydrogen 3.020 N/A VAL 199.A N ARG 196.A O no hydrogen 2.970 N/A LEU 202.A N PHE 198.A O no hydrogen 2.878 N/A ALA 203.A N VAL 199.A O no hydrogen 2.939 N/A ARG 204.A N PRO 200.A O no hydrogen 2.951 N/A ALA 205.A N VAL 201.A O no hydrogen 3.141 N/A ALA 206.A N LEU 202.A O no hydrogen 2.841 N/A VAL 207.A N ALA 203.A O no hydrogen 2.968 N/A ALA 208.A N ARG 204.A O no hydrogen 2.992 N/A THR 209.A N ALA 205.A O no hydrogen 2.890 N/A THR 209.A OG1 ALA 205.A O no hydrogen 2.757 N/A GLY 210.A N ALA 206.A O no hydrogen 2.944 N/A ALA 212.A N VAL 182.A O no hydrogen 2.892 N/A GLY 213.A N VAL 182.A O no hydrogen 3.256 N/A LEU 214.A N PHE 16.A O no hydrogen 2.962 N/A PHE 215.A N PHE 184.A O no hydrogen 2.774 N/A MET 216.A N ILE 18.A O no hydrogen 2.966 N/A GLU 217.A N THR 187.A OG1 no hydrogen 2.782 N/A THR 218.A N GLY 20.A O no hydrogen 3.053 N/A THR 218.A OG1 VAL 233.A O no hydrogen 2.529 N/A HIS 219.A N VAL 233.A O no hydrogen 3.236 N/A HIS 219.A NE2 GLU 25.A OE1 no hydrogen 2.963 N/A ASN 221.A N HIS 219.A ND1 no hydrogen 3.077 N/A GLU 224.A N ASN 221.A O no hydrogen 2.897 N/A ALA 225.A N PRO 222.A O no hydrogen 3.026 N/A LYS 226.A N GLU 25.A OE2 no hydrogen 3.016 N/A ASN 231.A N ASP 228.A O no hydrogen 2.814 N/A ALA 232.A N GLY 229.A O no hydrogen 3.170 N/A VAL 233.A N GLU 217.A O no hydrogen 3.022 N/A LEU 235.A N HIS 219.A O no hydrogen 2.907 N/A ARG 237.A N PRO 234.A O no hydrogen 2.832 N/A ARG 237.A NH1 ASN 236.A O no hydrogen 3.110 N/A MET 238.A N LEU 235.A O no hydrogen 3.108 N/A LEU 241.A N ARG 237.A O no hydrogen 3.236 N/A LEU 242.A N MET 238.A O no hydrogen 2.846 N/A GLU 243.A N GLY 239.A O no hydrogen 2.860 N/A THR 244.A N ALA 240.A O no hydrogen 3.154 N/A THR 244.A OG1 ALA 240.A O no hydrogen 3.228 N/A LEU 245.A N LEU 241.A O no hydrogen 2.848 N/A VAL 246.A N LEU 242.A O no hydrogen 2.794 N/A THR 247.A N GLU 243.A O no hydrogen 3.307 N/A THR 247.A OG1 GLU 243.A O no hydrogen 3.174 N/A LEU 248.A N THR 244.A O no hydrogen 3.122 N/A ASP 249.A N LEU 245.A O no hydrogen 2.830 N/A GLN 250.A N VAL 246.A O no hydrogen 2.869 N/A ALA 251.A N THR 247.A O no hydrogen 2.887 N/A VAL 252.A N LEU 248.A O no hydrogen 2.999 N/A LYS 253.A N ASP 249.A O no hydrogen 3.109 N/A LYS 253.A NZ GLN 13.A O no hydrogen 2.639 N/A LYS 253.A NZ VAL 211.A O no hydrogen 2.892 N/A LYS 253.A NZ ASP 249.A OD1 no hydrogen 2.799 N/A GLU 259.A N GLU 259.A OE1 no hydrogen 2.699 N/A ASN 260.A N PHE 257.A O no hydrogen 3.112 N/A ASP 261.A N LEU 258.A O no hydrogen 2.950 N/A PHE 262.A N GLU 259.A O no hydrogen 3.127 N/A